SMILES:
Fc1ccc(Nc2ncnc3c2CN(c2ncccc2Cl)CC3)cc1Molecular Processing
Molecular formula
C18H15ClFN5
Molecular weight
355.8
Exact mass
355.1
XLogP
3.97
TPSA
53.94
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
95.72
Supplementary Information
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